Id |
Subject |
Object |
Predicate |
Lexical cue |
T99 |
0-159 |
Sentence |
denotes |
ADP ribose phosphatase (ADRP) serves to convert ADP-ribose 1″-monophosphate (Appr-1″-p) to ADP-ribose (Appr), which serves to regulate virus replication [110]. |
T100 |
160-220 |
Sentence |
denotes |
This enzyme may be dispensable in SARS-CoV-2, however [111]. |
T101 |
221-332 |
Sentence |
denotes |
Nevertheless, (E,E)-farnesol showed the most exothermic docking to SARS-CoV-2 ADRP with DSnorm = −121.4 kJ/mol. |
T102 |
333-509 |
Sentence |
denotes |
The binding site in SARS-CoV-2 ADRP is surrounded by Phe132, Asn40, Ile131, Ala38, and Ala39, with hydrogen-bonded interactions between the ligand alcohol and Asn40 (Figure 4). |
T103 |
510-960 |
Sentence |
denotes |
Additional essential oil components with good docking scores with SARS-CoV-2 ADRP include the sesquiterpene hydrocarbons (E)-β-farnesene (DSnorm = −116.3 kJ/mol), (E,E)-α-farnesene (DSnorm = −114.2 kJ/mol), β-sesquiphellandrene (DSnorm = −115.7 kJ/mol), and α-zingiberene (DSnorm = −115.4 kJ/mol); the diterpenoids phytol (DSnorm = −118.9 kJ/mol) and phytone (DSnorm = −116.9 kJ/mol); and the phenylpropanoid eugenyl acetate (DSnorm = −115.4 kJ/mol). |
T104 |
961-1101 |
Sentence |
denotes |
Not surprisingly, β-sesquiphellandrene and α-zingiberene adopted the same docking orientation in the binding site of the enzyme (Figure 5A). |
T105 |
1102-1189 |
Sentence |
denotes |
Similarly, phytol and phytone occupy the same location in the binding site (Figure 5B). |